N-(1,3-benzothiazol-2-ylcarbamothioyl)hexanamide

Systemtic Name: N-(1,3-benzothiazol-2-ylcarbamothioyl)hexanamide Openeye Name: N-(1,3-benzothiazol-2-ylcarbamothioyl)hexanamide CAS Name: N-[(1,3-benzothiazol-2-ylamino)-sulfanylidenemethyl]hexanamide IUPAC Name: N-(1,3-benzothiazol-2-ylcarbamothioyl)hexanamide Traditional Name: N-(1,3-benzothiazol-2-ylthiocarbamoyl)hexanamide Formula: C14H17N3OS2 MolecularWeight: 307.43428

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)NC(=S)NC1=NC2=CC=CC=C2S1

Isomeric SMILES

CCCCCC(=O)NC(=S)NC1=NC2=CC=CC=C2S1

InChI

InChI=1S/C14H17N3OS2/c1-2-3-4-9-12(18)16-13(19)17-14-15-10-7-5-6-8-11(10)20-14/h5-8H,2-4,9H2,1H3,(H2,15,16,17,18,19)